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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Corticotropin-releasing factor receptor 1' and Ligand = 'BDBM131862'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Corticotropin-releasing factor receptor 1


(Homo sapiens (Human))
BDBM131862
PNG
(US8835444, 2.3)
Show SMILES Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](Cn2cc3CCCCc3n2)CC1 |r,wU:14.15,wD:11.11,(-3.71,-2.69,;-5.04,-1.93,;-6.37,-2.69,;-7.71,-1.93,;-7.71,-.38,;-9.04,.38,;-6.37,.38,;-5.04,-.38,;-3.71,.38,;-3.71,1.93,;-2.37,-.38,;-1.04,.38,;.29,-.38,;1.63,.38,;1.63,1.93,;2.96,2.69,;4.29,1.93,;4.46,.39,;5.96,.07,;6.73,-1.26,;8.27,-1.26,;9.04,.07,;8.27,1.41,;6.73,1.41,;5.7,2.55,;.29,2.69,;-1.04,1.93,)|
Show InChI InChI=1S/C21H27ClN4O/c1-14-19(10-17(22)11-23-14)21(27)24-18-8-6-15(7-9-18)12-26-13-16-4-2-3-5-20(16)25-26/h10-11,13,15,18H,2-9,12H2,1H3,(H,24,27)/t15-,18-
PDB
MMDB

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Similars

US Patent
n/an/a 318n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Chinese hamster ovary (CHO) cells expressing either the human or rat recombinant CRF-1 or human CRF-2alpha (Chen et al, Proc Natl Acad Sci USA 90, 89...


US Patent US8835444 (2014)


BindingDB Entry DOI: 10.7270/Q28K77ST
More data for this
Ligand-Target Pair